CID 173076718

HAsFeO — CID 173076718

IUPAC—
SMILESO[As].[Fe]
InChIInChI=1S/AsHO.Fe/c1-2;/h2H;
InChIKeyLJXUEKAENHMNBQ-UHFFFAOYSA-N
MW147.77 g/mol
LogP-0.94
Rot. Bonds

About CID 173076718

CID 173076718 (PubChem CID 173076718) has the molecular formula HAsFeO and a molecular weight of 147.77 g/mol.

Molecular Properties

Compound NameCID 173076718
PubChem CID173076718
Molecular FormulaHAsFeO
Molecular Weight147.77 g/mol
Exact Mass147.86
IUPAC Name—
SMILESO[As].[Fe]
InChIInChI=1S/AsHO.Fe/c1-2;/h2H;
InChIKeyLJXUEKAENHMNBQ-UHFFFAOYSA-N
XLogP-0.94
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms3
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.77
LogP ≤ 5-0.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 173076718?
The IUPAC name of CID 173076718 (CID 173076718) is not available.
What is the SMILES notation for CID 173076718?
The canonical SMILES for CID 173076718 is O[As].[Fe].
What is the InChIKey of CID 173076718?
The InChIKey is LJXUEKAENHMNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/AsHO.Fe/c1-2;/h2H;.
What are the key properties of CID 173076718?
CID 173076718 has a molecular weight of 147.77 g/mol, XLogP of -0.94, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173076718 is sourced from PubChem (CID 173076718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).